1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole
TL;DR: 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole (CAS 328277-17-4) is a chemical compound with molecular formula C13H16N2O4S and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-dimethoxyphenyl)sulfonyl-3,5-dimethylpyrazole
Also Known As: BAS 01400732, 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole, 1-(2,5-dimethoxyphenyl)sulfonyl-3,5-dimethylpyrazole, 1-[(2,5-dimethoxyphenyl)sulfonyl]-3,5-dimethyl-1H-pyrazole, 1-[(2,5-dimethoxyphenyl)sulfonyl]-3,5-dimethylpyrazole
| Molecular Formula | C13H16N2O4S |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.08307 |
| Heavy Atoms | 20 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 328277-17-4 |
|---|---|
| SMILES | CC1=CC(=NN1S(=O)(=O)C2=C(C=CC(=C2)OC)OC)C |
| InChIKey | XNABKIAWALLOHA-UHFFFAOYSA-N |
Product Overview
1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole (CAS 328277-17-4), with molecular formula C13H16N2O4S and molecular weight 296.08 g/mol. IUPAC: 1-(2,5-dimethoxyphenyl)sulfonyl-3,5-dimethylpyrazole.
Chemical Property Profile of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole
Property Insights of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole. Following Lipinski's Rule of Five, 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole?
The CAS number of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole is 328277-17-4.
What is the molecular formula of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole?
The molecular formula of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole is C13H16N2O4S.
What is the molecular weight of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole?
The molecular weight of 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole is 296.08 g/mol.
Where can I buy 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole?
You can request a quote for 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5-Dimethoxy-benzenesulfonyl)-3,5-dimethyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.